Base information
| Cat. No. | |
| CAS No. | 69829-90-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6N2O2S |
| Molecular Weight | 194.21 |
| Exact Mass | 194.015 |
| XLogP3 | 2.1048 |
| Mr | 49.1467 |
| PSA | 94.14 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Oc1ccc(cc1)c1n[nH]c(=S)o1 |
